[2-[(4-methylphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] 4-(2,5-dimethylthiophen-3-yl)-4-oxidanylidene-butanoate

Systemtic Name: [2-[(4-methylphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] 4-(2,5-dimethylthiophen-3-yl)-4-oxidanylidene-butanoate Openeye Name: [2-(4-methylanilino)-2-oxo-1-phenyl-ethyl] 4-(2,5-dimethyl-3-thienyl)-4-oxo-butanoate CAS Name: 4-(2,5-dimethyl-3-thiophenyl)-4-oxobutanoic acid [2-(4-methylanilino)-2-oxo-1-phenylethyl] ester IUPAC Name: [2-(4-methylanilino)-2-oxo-1-phenylethyl] 4-(2,5-dimethylthiophen-3-yl)-4-oxobutanoate Traditional Name: 4-(2,5-dimethyl-3-thienyl)-4-keto-butyric acid [2-keto-1-phenyl-2-(p-toluidino)ethyl] ester Formula: C25H25NO4S MolecularWeight: 435.5353

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C(C2=CC=CC=C2)OC(=O)CCC(=O)C3=C(SC(=C3)C)C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C(C2=CC=CC=C2)OC(=O)CCC(=O)C3=C(SC(=C3)C)C

InChI

InChI=1S/C25H25NO4S/c1-16-9-11-20(12-10-16)26-25(29)24(19-7-5-4-6-8-19)30-23(28)14-13-22(27)21-15-17(2)31-18(21)3/h4-12,15,24H,13-14H2,1-3H3,(H,26,29)